Accelerating virtual high-throughput ligand docking: current technology and case study on a petascale supercomputer.
Sally R. EllingsonDakshanamurthy SivanesanMilton BrownJeremy C. SmithJérôme BaudryPublished in: Concurr. Comput. Pract. Exp. (2014)
Keyphrases
- high throughput
- case study
- ligand docking
- microarray
- genome wide
- biological data
- systems biology
- low latency
- massively parallel
- protein protein interactions
- dna sequencing
- data acquisition
- mass spectrometry
- high performance computing
- real world
- data sets
- biological knowledge
- databases
- real time
- microarray data
- genomic data
- gene expression
- wireless sensor networks
- analysis of gene expression
- low cost